(6R)-N,2-dimethyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-6-amine

C8H13N3O — CID 138579605

IUPAC(6R)-N,2-dimethyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-6-amine
SMILESCN[C@H]1COc2cc(C)nn2C1
InChIInChI=1S/C8H13N3O/c1-6-3-8-11(10-6)4-7(9-2)5-12-8/h3,7,9H,4-5H2,1-2H3/t7-/m1/s1
InChIKeyUVEVTQYQGQVCPM-SSDOTTSWSA-N
MW167.21 g/mol
LogP0.17
Rot. Bonds1

About (6R)-N,2-dimethyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-6-amine

(6R)-N,2-dimethyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-6-amine (PubChem CID 138579605) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is (6R)-N,2-dimethyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-6-amine.

Molecular Properties

Compound Name(6R)-N,2-dimethyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-6-amine
PubChem CID138579605
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name(6R)-N,2-dimethyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-6-amine
SMILESCN[C@H]1COc2cc(C)nn2C1
InChIInChI=1S/C8H13N3O/c1-6-3-8-11(10-6)4-7(9-2)5-12-8/h3,7,9H,4-5H2,1-2H3/t7-/m1/s1
InChIKeyUVEVTQYQGQVCPM-SSDOTTSWSA-N
XLogP0.17
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 50.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (6R)-N,2-dimethyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-6-amine?
The IUPAC name of (6R)-N,2-dimethyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-6-amine (CID 138579605) is (6R)-N,2-dimethyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-6-amine.
What is the SMILES notation for (6R)-N,2-dimethyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-6-amine?
The canonical SMILES for (6R)-N,2-dimethyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-6-amine is CN[C@H]1COc2cc(C)nn2C1.
What is the InChIKey of (6R)-N,2-dimethyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-6-amine?
The InChIKey is UVEVTQYQGQVCPM-SSDOTTSWSA-N. The full InChI is InChI=1S/C8H13N3O/c1-6-3-8-11(10-6)4-7(9-2)5-12-8/h3,7,9H,4-5H2,1-2H3/t7-/m1/s1.
What are the key properties of (6R)-N,2-dimethyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-6-amine?
(6R)-N,2-dimethyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-6-amine has a molecular weight of 167.21 g/mol, XLogP of 0.17, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-N,2-dimethyl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazin-6-amine is sourced from PubChem (CID 138579605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).